0 mol 14 unq 0 iso 0 dist 8.13983 5.2767 8.73627 5.63648 6.38364 9.18933 11.0431 5.38909 8.69369 10.7133 numMergedOcc 0
1 mol 14 unq 1 iso 0 dist 6.45858 8.1206 8.73627 4.05028 6.38364 9.18933 10.9113 5.38909 8.69369 10.7133 numMergedOcc 0
2 mol 16 unq 0 iso 0 dist 9.76968 5.98953 5.84479 4.2139 6.31718 5.35079 13.862 5.32694 8.67719 10.9143 numMergedOcc 0
3 mol 16 unq 1 iso 0 dist 9.76968 5.98953 5.84479 12.1754 7.63133 6.53177 13.862 5.32694 8.67719 5.46498 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 5.97635 6.31564 6.59893 10.7219 9.5589 11.9881 13.1075 13.0997 9.06005 11.5304 numMergedOcc 0
5 mol 54 unq 1 iso 0 dist 5.97635 6.31564 6.59893 6.76462 6.83299 10.3564 13.1075 13.0997 9.06005 13.4839 numMergedOcc 0
6 mol 54 unq 2 iso 0 dist 5.97635 6.31564 6.59893 13.2619 8.10861 12.4254 13.1075 13.0997 9.06005 19.0928 numMergedOcc 0
7 mol 58 unq 0 iso 0 dist 6.36193 7.63046 7.84983 5.40367 6.62496 11.5882 4.88613 4.81926 9.56737 6.35756 numMergedOcc 0
8 mol 58 unq 1 iso 0 dist 4.88613 7.63046 9.56737 5.40367 6.35756 11.5882 6.36193 4.81926 7.84983 6.62496 numMergedOcc 0
9 mol 224 unq 0 iso 0 dist 8.39002 9.97999 9.33771 9.98893 8.95269 5.41021 8.46129 5.0744 7.39839 9.99123 numMergedOcc 0
10 mol 224 unq 1 iso 0 dist 8.39002 9.97999 9.33771 5.72088 6.57273 4.91322 8.46129 5.0744 7.39839 6.60589 numMergedOcc 0
11 mol 224 unq 2 iso 0 dist 8.39002 9.97999 9.33771 6.51315 5.78342 12.979 8.46129 5.0744 7.39839 9.16166 numMergedOcc 0
12 mol 224 unq 3 iso 0 dist 8.46129 9.97999 7.39839 6.31508 6.65832 7.65225 8.39002 5.0744 9.33771 10.103 numMergedOcc 0
13 mol 224 unq 4 iso 0 dist 8.46129 9.97999 7.39839 5.72088 6.60589 4.91322 8.39002 5.0744 9.33771 6.57273 numMergedOcc 0
14 mol 224 unq 5 iso 0 dist 8.46129 9.97999 7.39839 6.51315 9.16166 12.979 8.39002 5.0744 9.33771 5.78342 numMergedOcc 0
15 mol 231 unq 0 iso 0 dist 8.01942 7.25343 6.14348 8.55683 8.40182 5.3251 9.97221 4.06055 7.79865 7.37839 numMergedOcc 0
16 mol 236 unq 0 iso 0 dist 9.05929 6.83211 8.77254 4.32403 8.04248 5.74377 14.1068 6.99332 9.96976 12.2364 numMergedOcc 0
17 mol 236 unq 1 iso 0 dist 9.05929 6.83211 8.77254 4.38595 8.35971 10.054 14.1068 6.99332 9.96976 14.664 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 9.13537 4.34203 6.83152 10.3859 6.57393 10.8336 9.01016 5.42006 5.24313 11.101 numMergedOcc 0
19 mol 249 unq 0 iso 0 dist 6.37672 11.3437 7.29898 9.07501 7.57994 6.6173 12.8391 8.34718 5.78121 11.7594 numMergedOcc 0
20 mol 249 unq 1 iso 0 dist 6.37672 11.3437 7.29898 4.24014 6.18582 8.95486 12.8391 8.34718 5.78121 12.2913 numMergedOcc 0
21 mol 249 unq 2 iso 0 dist 8.94023 11.2158 7.29898 9.53929 7.57994 6.6173 12.9036 8.34718 5.78121 11.7594 numMergedOcc 0
22 mol 249 unq 3 iso 0 dist 8.94023 11.2158 7.29898 5.36989 6.18582 8.95486 12.9036 8.34718 5.78121 12.2913 numMergedOcc 0
23 mol 259 unq 0 iso 0 dist 5.90645 6.13878 6.77279 4.62072 8.53687 7.55268 9.73107 4.69778 9.58006 10.5767 numMergedOcc 0
24 mol 259 unq 1 iso 0 dist 5.90645 6.13878 6.77279 10.4985 8.13497 5.71237 9.73107 4.69778 9.58006 7.88519 numMergedOcc 0
25 mol 277 unq 0 iso 0 dist 9.29635 15.5244 6.90434 10.8075 9.7748 13.2927 21.9597 12.7728 8.57532 19.7909 numMergedOcc 0
26 mol 277 unq 1 iso 0 dist 9.29635 15.5244 6.90434 10.8075 9.7748 13.2927 14.3464 7.08227 9.02914 16.3537 numMergedOcc 0
